N-[(5-methylpyrazin-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine

C14H21N5 — CID 105148936

IUPACN-[(5-methylpyrazin-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine
SMILESCCCn1ccnc1C(NCC)c1cnc(C)cn1
InChIInChI=1S/C14H21N5/c1-4-7-19-8-6-16-14(19)13(15-5-2)12-10-17-11(3)9-18-12/h6,8-10,13,15H,4-5,7H2,1-3H3
InChIKeyLXKUSDSALGVYMZ-UHFFFAOYSA-N
MW259.36 g/mol
LogP2.09
Rot. Bonds6

About N-[(5-methylpyrazin-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine

N-[(5-methylpyrazin-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine (PubChem CID 105148936) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is N-[(5-methylpyrazin-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(5-methylpyrazin-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine
PubChem CID105148936
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC NameN-[(5-methylpyrazin-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine
SMILESCCCn1ccnc1C(NCC)c1cnc(C)cn1
InChIInChI=1S/C14H21N5/c1-4-7-19-8-6-16-14(19)13(15-5-2)12-10-17-11(3)9-18-12/h6,8-10,13,15H,4-5,7H2,1-3H3
InChIKeyLXKUSDSALGVYMZ-UHFFFAOYSA-N
XLogP2.09
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(6-methoxypyridazin-3-yl)-(1-propylimidazol-2-yl)methyl]ethanamine
CID 103374471
N-[(3-methylthiophen-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine
CID 61318152
N-ethyl-2-(1-ethylimidazol-2-yl)-1-(5-methylpyrazin-2-yl)ethanamine
CID 105165931
N-[(3,5-dichloro-2-pyridinyl)-(1-propylimidazol-2-yl)methyl]ethanamine
CID 79780571
N-[(4-bromo-2-methylphenyl)-(1-propylimidazol-2-yl)methyl]ethanamine
CID 61318558
N-[(5-bromo-4-methylthiophen-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine
CID 79996590
N-ethyl-2-methyl-1-(1-propylimidazol-2-yl)propan-1-amine
CID 63967916
N-[(3-fluorophenyl)-(1-propylimidazol-2-yl)methyl]ethanamine
CID 61317740
N-[(1,3-diethylpyrazol-5-yl)-(1-propylimidazol-2-yl)methyl]ethanamine
CID 105148852
N-[(3,5-dimethylphenyl)-(5-methylpyrazin-2-yl)methyl]ethanamine
CID 105097208
N-ethyl-2-methoxy-1-(1-propylimidazol-2-yl)ethanamine
CID 63970852
N-[(1-ethylimidazol-2-yl)-(2-methyl-1,3-thiazol-4-yl)methyl]ethanamine
CID 65199087

Frequently Asked Questions

What is the IUPAC name of N-[(5-methylpyrazin-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine?
The IUPAC name of N-[(5-methylpyrazin-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine (CID 105148936) is N-[(5-methylpyrazin-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine.
What is the SMILES notation for N-[(5-methylpyrazin-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine?
The canonical SMILES for N-[(5-methylpyrazin-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine is CCCn1ccnc1C(NCC)c1cnc(C)cn1.
What is the InChIKey of N-[(5-methylpyrazin-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine?
The InChIKey is LXKUSDSALGVYMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-4-7-19-8-6-16-14(19)13(15-5-2)12-10-17-11(3)9-18-12/h6,8-10,13,15H,4-5,7H2,1-3H3.
What are the key properties of N-[(5-methylpyrazin-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine?
N-[(5-methylpyrazin-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine has a molecular weight of 259.36 g/mol, XLogP of 2.09, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methylpyrazin-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine is sourced from PubChem (CID 105148936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).